ethyl 1-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-2,3,4,5-tetrahydropyridin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-2,3,4,5-tetrahydropyridin-1-ium-4-carboxylate Openeye Name: ethyl 1-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-2,3,4,5-tetrahydropyridin-1-ium-4-carboxylate CAS Name: 1-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-2,3,4,5-tetrahydropyridin-1-ium-4-carboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-2,3,4,5-tetrahydropyridin-1-ium-4-carboxylate Traditional Name: 1-[2-(4-fluorophenyl)-1H-imidazol-5-yl]-2,3,4,5-tetrahydropyridin-1-ium-4-carboxylic acid ethyl ester Formula: C17H19FN3O2+ MolecularWeight: 316.350063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[N+](=CC1)C2=CN=C(N2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CC[N+](=CC1)C2=CN=C(N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN3O2/c1-2-23-17(22)13-7-9-21(10-8-13)15-11-19-16(20-15)12-3-5-14(18)6-4-12/h3-6,9,11,13H,2,7-8,10H2,1H3,(H,19,20)/q+1